SCHEMBL5587863

SCHEMBL5587863

CCc1cc(O)c(O)c(C(=O)O)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.43
PTPN11 Q06124 2/20 0.43
LDHA P00338 5/20 0.42
LDHB P07195 5/20 0.42
CYP3A4 P08684 2/20 0.41
ACHE P22303 1/20 0.41
GLRA3 O75311 1/20 0.41
GLRB P48167 1/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.39
CA12 O43570 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
CA3 P07451 1/20 0.39
SELL P14151 1/20 0.39
HPGD P15428 1/20 0.39
SELP P16109 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5678031 0.87 PTPN1 (0.56) PTPN1PTPN11LDHALDHBCYP3A4
SCHEMBL5590530 0.84 BID (0.48) PTPN1PTPN11MAPTKDM4EHSD17B10
SCHEMBL5680819 0.83 PTPN1 (0.37) PTPN1PTPN11LDHALDHBCYP3A4
SCHEMBL5193720 0.83 BID (0.54) PTPN1MAPTKDM4EHSD17B10BCL2L1
SCHEMBL31643660 0.81 PTPN1 (0.41) PTPN1PTPN11LDHALDHBCYP3A4
SCHEMBL31058734 0.81 PTPN1 (0.43) PTPN1PTPN11LDHALDHBCYP3A4
SCHEMBL5589785 0.81 PTPN1 (0.43) PTPN1PTPN11LDHALDHBCYP3A4
SCHEMBL5588929 0.78 CYP3A4 (0.52) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL5680659 0.78 PTPN1 (0.45) PTPN1PTPN11LDHALDHBKDM4E
SCHEMBL1375521 0.78 NR1H2 (0.57) PTPN1PTPN11CYP3A4KDM4ECA12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7247687-B2 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-07-24 US disclosed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP disclosed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US disclosed
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP disclosed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP disclosed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR PTPN1 4673/4885PTPN11 4670/4885LDHA 3482/4885
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 PTPN1 4679/4885PTPN11 4354/4885LDHA 320/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.